These data  files are used for the plots in the main text:

Fig. 2c: Molecular Dynamics\Fig2_0Ca.xsd~Fig2_0_5Ca.xsd
Fig. 4d, 4e: DFT\G1_Li2S_Outmol.txt~G1_S_Outmol.txt, DFT\CaS_Li2S_Outmol.txt~CaS_S_Outmol.txt
Fig. 6a: Molecular Dynamics\Fig6_Ca_I.xsd
